⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8014641 | 0.98 | KMT2A (0.37) | — | |
| SCHEMBL12648597 | 0.75 | — | — | |
| SCHEMBL12648729 | 0.75 | — | — | |
| SCHEMBL82278 | 0.75 | — | — | |
| SCHEMBL25008575 | 0.71 | GRM5 (0.37) | — | |
| SCHEMBL8902606 | 0.69 | KMT2A (0.57) | — | |
| SCHEMBL14554141 | 0.68 | MAPT (0.37) | — | |
| SCHEMBL23773703 | 0.67 | KMT2A (0.34) | — | |
| SCHEMBL6938330 | 0.64 | KMT2A (0.32) | — | |
| SCHEMBL22702325 | 0.63 | KMT2A (0.34) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6034083-A | AGRICULTURAL INSECTICIDE | NOVARTIS CORP. (US) | 2000-03-07 | — | — | US | disclosed |
| US-5783704-A | INSECTICIDES; FOR AGRICULTURE PRODUCTS | NOVARTIS CORPORATION (US) | 1998-07-21 | — | — | US | disclosed |
| EP-0737191-A1 | PYRIDINE DERIVATIVES AS PESTICIDES | Novartis AG (CH) | 1996-10-16 | — | — | EP | disclosed |
| WO-1995018123-A1 | PYRIDINE DERIVATIVES AS PESTICIDES | CIBA-GEIGY AG (CH) | 1995-07-06 | — | — | WO | disclosed |